Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | MITF | O75030 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28504221 | 0.91 | ALDH1A1 (0.33) | ALDH1A1LMNATDP1L3MBTL1MITF | |
| SCHEMBL28503247 | 0.84 | PDCD1 (0.35) | ALDH1A1PDCD1CD274DPP4MITF | |
| SCHEMBL28494645 | 0.83 | TACR1 (0.38) | ALDH1A1PDCD1CD274DPP4MITF | |
| SCHEMBL28506921 | 0.80 | CYP11B1 (0.39) | LMNAPDCD1CD274HTT | |
| SCHEMBL28494589 | 0.80 | TACR1 (0.36) | ALDH1A1PDCD1CD274MITFMAPT | |
| SCHEMBL9359481 | 0.78 | LMNA (0.33) | ALDH1A1LMNAL3MBTL1MAPT | |
| SCHEMBL28495517 | 0.77 | CYP11B1 (0.36) | PDCD1CD274 | |
| SCHEMBL776889 | 0.70 | DPP4 (0.58) | ALDH1A1LMNATDP1L3MBTL1PDCD1 | |
| SCHEMBL6569636 | 0.70 | ALDH1A1 (0.40) | ALDH1A1LMNATDP1L3MBTL1MITF | |
| SCHEMBL28503244 | 0.65 | LMNA (0.35) | ALDH1A1LMNATDP1L3MBTL1PDCD1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111620914-B | Side-arm metallocene tetravalent transition metal complex containing neutral benzyl heteroatom ligand and application thereof | 吉林大学 | 2021-03-19 | — | — | CN | disclosed |
| CN-111620914-A | Side-arm metallocene tetravalent transition metal complex containing neutral benzyl heteroatom ligand and application thereof | 吉林大学 | 2020-09-04 | — | — | CN | disclosed |